C,1,56.1,s,
O,2,,,
C,3,154.7,s,
C,4,111.4,s,
C,5,129.15,s,
C,6,130.6,s,
C,7,133.6,s,
C,8,127.5,s,
C,9,127.5,s,
C,10,128.7,s,
C,11,136.46,s,
C,12,124.37,s,
C,13,111.97,s,
C,14,154.7,s,
O,15,,,
C,16,56.1,s,
C,17,61.76,s,
C,18,36.65,s,
C,19,76.51,s,
O,20,,,
C,21,170.72,s,
C,22,21.03,s,
O,23,,,
C,24,78.37,s,
O,25,,,
C,26,169.94,s,
C,27,20.78,s,
O,28,,,
C,29,63.83,s,
C,30,28.47,s,
C,31,21.45,s,
C,32,31.72,s,
C,33,58.68,s,
C,34,36.08,s,
C,35,74.13,s,
O,36,,,
C,37,170.62,s,
C,38,22.29,s,
O,39,,,
C,40,34.37,s,
C,41,30.3,s,
N,42,,,
H,43,3.7,s,
H,44,3.7,s,
H,45,3.7,s,
H,46,7.0,dd,"7.5,0.5"
H,47,6.92,dd,"7.5,1.9"
H,48,7.61,dt,"1.9,0.5"
H,49,7.61,dt,"1.9,0.5"
H,50,7.05,dd,"10.4,1.9"
H,51,7.0,dd,"10.4,0.5"
H,52,3.7,s,
H,53,3.7,s,
H,54,3.7,s,
H,55,4.75,dd,"22.4,14.9"
H,56,2.45,ddd,"22.4,12.4,1.1"
H,57,2.45,ddd,"14.9,12.4,8.6"
H,58,4.61,ddd,"8.6,6.7,1.1"
H,59,2.02,s,
H,60,2.02,s,
H,61,2.02,s,
H,62,4.91,dd,"18.9,6.7"
H,63,1.95,s,
H,64,1.95,s,
H,65,1.95,s,
H,66,3.41,ddd,"18.9,12.1,4.6"
H,67,1.84,m,
H,68,1.84,m,
H,69,1.37,m,
H,70,1.37,m,
H,71,1.51,m,
H,72,1.51,m,
H,73,3.77,m,
H,74,2.2,ddd,"16.7,14.6,12.4"
H,75,2.2,ddd,"19.5,12.4,11.7"
H,76,4.83,m,
H,77,2.03,s,
H,78,2.03,s,
H,79,2.03,s,
H,80,1.8,dtd,"18.8,12.4,5.2"
H,81,1.8,m,
H,82,2.81,ddd,"15.4,12.4,7.4"
H,83,2.81,ddd,"18.8,15.4,13.8"
